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構造リスト
JCGGDB Glycan Structure
Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
JCGGDB ID
JCGG-STR028222
GlyTouCan
G67069KV
version 2
Glycan Information
Glyco Tree
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Composition
Hex 2 Pen 1
Mass Value Search
Glc 2 Xyl 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
APSAECJOBMPPBM-HQQXLHOFSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
7
H
3
0
O
1
5
/
c
1
8
-
1
-
5
-
8
(
2
1
)
1
0
(
2
3
)
1
3
(
2
6
)
1
7
(
3
1
-
5
)
3
2
-
1
4
-
1
1
(
2
4
)
9
(
2
2
)
6
(
3
0
-
1
5
(
1
4
)
2
7
)
3
-
2
9
-
1
6
-
1
2
(
2
5
)
7
(
2
0
)
4
(
1
9
)
2
-
2
8
-
1
6
/
h
4
-
2
7
H
,
1
-
3
H
2
/
t
4
-
,
5
-
,
6
-
,
7
+
,
8
-
,
9
-
,
1
0
+
,
1
1
+
,
1
2
-
,
1
3
-
,
1
4
-
,
1
5
-
,
1
6
+
,
1
7
+
/
m
1
/
s
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SMILES
OC[C@H]1O[C@@H](O[C@H]2[C@H](O)O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
474.1584
474.4161
Permethylated
Oligosaccharides
614.3151
614.6849
Peracetylated
Oligosaccharides
894.2641
894.7889
External Links
GlycomeDB
(Structure)
GlycomeDB
7113
7113
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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